2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-methylcyclohexyl)benzamide

Systemtic Name: 2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(2-methylcyclohexyl)benzamide Openeye Name: 2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]sulfanyl-N-(2-methylcyclohexyl)benzamide CAS Name: 2-[[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]thio]-N-(2-methylcyclohexyl)benzamide IUPAC Name: 2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-N-(2-methylcyclohexyl)benzamide Traditional Name: 2-[[2-(homoveratrylamino)-2-keto-ethyl]thio]-N-(2-methylcyclohexyl)benzamide Formula: C26H34N2O4S MolecularWeight: 470.62416

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)C2=CC=CC=C2SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1CCCCC1NC(=O)C2=CC=CC=C2SCC(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C26H34N2O4S/c1-18-8-4-6-10-21(18)28-26(30)20-9-5-7-11-24(20)33-17-25(29)27-15-14-19-12-13-22(31-2)23(16-19)32-3/h5,7,9,11-13,16,18,21H,4,6,8,10,14-15,17H2,1-3H3,(H,27,29)(H,28,30)